| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 17 | Yes |
Popular Name: (1S)-N-[(1R)-1-cyclohexylethyl]-1-(4-methyl-1,2,4-triazol-3-yl)ethanamine (1S)-N-[(1R)-1-cyclohexylethyl]-…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 2.30 | 8.12 | -41.37 | 2 | 4 | 1 | 47 | 237.371 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.30 | 7.39 | -8.81 | 1 | 4 | 0 | 43 | 236.363 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
